In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | Yes |
Popular Name: 6-methyl-2-[methyl(3-pyridylmethyl)amino]pyridine-3-carbonitrile 6-methyl-2-[methyl(3-pyridylmeth…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.06 | 7.57 | -8.64 | 0 | 4 | 0 | 53 | 238.294 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.06 | 8.04 | -35.62 | 1 | 4 | 1 | 54 | 239.302 | 3 | ↓ |